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Information card for entry 7246928
Preview
| Coordinates | 7246928.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H33.52 Cl6 Mn N2 |
|---|---|
| Calculated formula | C14 H34 Cl6 Mn N2 |
| Title of publication | Dielectric and optical properties of a new organic–inorganic hybrid phase transition material |
| Authors of publication | Zhang, Yinan; Cai, Zhuoer; Zhang, Xinyi; Xiao, Shiyue; Liu, Xianmin; Zhao, Yingyi; Hua, Xiu-Ni; Sun, Baiwang |
| Journal of publication | CrystEngComm |
| Year of publication | 2023 |
| Journal volume | 25 |
| Journal issue | 30 |
| Pages of publication | 4284 - 4289 |
| a | 12.952 ± 0.0009 Å |
| b | 13.4792 ± 0.001 Å |
| c | 15.8481 ± 0.0012 Å |
| α | 110.169 ± 0.002° |
| β | 113.276 ± 0.002° |
| γ | 90.899 ± 0.003° |
| Cell volume | 2348.4 ± 0.3 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1144 |
| Residual factor for significantly intense reflections | 0.078 |
| Weighted residual factors for significantly intense reflections | 0.1954 |
| Weighted residual factors for all reflections included in the refinement | 0.2177 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 286116 (current) | 2023-09-05 | cif/ Updating files of 7246928, 7246929 Original log message: Adding full bibliography for 7246928--7246929.cif. |
7246928.cif |
| 284596 | 2023-06-29 | cif/ Adding structures of 7246928, 7246929 via cif-deposit CGI script. |
7246928.cif |
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Users of the data should acknowledge the original authors of the
structural data.